BUPRENORPHINE


SMILES CC(C)(C)C(C)(C1CC23CCC1(C4C25CCN(C3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)O
InChIKey RMRJXGBAOAMLHD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 467.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 8.35 8.41 8.54 PDSP Ki database
κ OPRK Human Opioid A pKi 9.1 9.14 9.21 PDSP Ki database
κ OPRK Guinea pig Opioid A pKi 8.7 8.76 8.82 PDSP Ki database
δ A0A286XTF2 Guinea pig Opioid A pKi 8.8 8.85 8.89 PDSP Ki database
μ OPRM Human Opioid A pKi 6.0 8.52 9.68 PDSP Ki database
μ OPRM Rat Opioid A pKi 8.38 8.88 9.38 PDSP Ki database
δ OPRD Rat Opioid A pKi 7.59 7.59 7.59 PDSP Ki database
κ OPRK Rat Opioid A pKi 7.89 7.89 7.89 PDSP Ki database
δ OPRD Human Opioid A pKi 8.09 8.09 8.09 Drug Central
κ OPRK Human Opioid A pKi 8.05 8.05 8.05 Drug Central
μ OPRM Human Opioid A pKi 8.08 8.08 8.08 Drug Central
NOP OPRX Human Opioid A pKi 8.15 8.15 8.15 Drug Central
δ OPRD Rat Opioid A pKi 8.03 8.03 8.03 Drug Central
μ OPRM Rat Opioid A pKi 8.0 8.0 8.0 Drug Central
κ OPRK Guinea pig Opioid A pKi 8.03 8.03 8.03 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database